2-[[5,6-bis(bromanyl)-1H-indol-3-yl]carbonylamino]-3-methyl-butanoic acid

Systemtic Name: 2-[[5,6-bis(bromanyl)-1H-indol-3-yl]carbonylamino]-3-methyl-butanoic acid Openeye Name: 2-[(5,6-dibromo-1H-indole-3-carbonyl)amino]-3-methyl-butanoic acid CAS Name: 2-[[(5,6-dibromo-1H-indol-3-yl)-oxomethyl]amino]-3-methylbutanoic acid IUPAC Name: 2-[(5,6-dibromo-1H-indole-3-carbonyl)amino]-3-methylbutanoic acid Traditional Name: 2-[(5,6-dibromo-1H-indole-3-carbonyl)amino]-3-methyl-butyric acid Formula: C14H14Br2N2O3 MolecularWeight: 418.08056

Click to see the large picture

Descriptors Computed from Structure

Canonical SMILES:

CC(C)C(C(=O)O)NC(=O)C1=CNC2=CC(=C(C=C21)Br)Br

Isomeric SMILES

CC(C)C(C(=O)O)NC(=O)C1=CNC2=CC(=C(C=C21)Br)Br

InChI

InChI=1S/C14H14Br2N2O3/c1-6(2)12(14(20)21)18-13(19)8-5-17-11-4-10(16)9(15)3-7(8)11/h3-6,12,17H,1-2H3,(H,18,19)(H,20,21)